1-[(3-chloranyl-6-methoxy-1-benzothiophen-2-yl)carbonylamino]-3-[3-(trifluoromethyl)phenyl]thiourea

Systemtic Name: 1-[(3-chloranyl-6-methoxy-1-benzothiophen-2-yl)carbonylamino]-3-[3-(trifluoromethyl)phenyl]thiourea Openeye Name: 1-[(3-chloro-6-methoxy-benzothiophene-2-carbonyl)amino]-3-[3-(trifluoromethyl)phenyl]thiourea CAS Name: 1-[[(3-chloro-6-methoxy-1-benzothiophen-2-yl)-oxomethyl]amino]-3-[3-(trifluoromethyl)phenyl]thiourea IUPAC Name: 1-[(3-chloro-6-methoxy-1-benzothiophene-2-carbonyl)amino]-3-[3-(trifluoromethyl)phenyl]thiourea Traditional Name: 1-[(3-chloro-6-methoxy-benzothiophene-2-carbonyl)amino]-3-[3-(trifluoromethyl)phenyl]thiourea Formula: C18H13ClF3N3O2S2 MolecularWeight: 459.89293

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=C(S2)C(=O)NNC(=S)NC3=CC=CC(=C3)C(F)(F)F)Cl

Isomeric SMILES

COC1=CC2=C(C=C1)C(=C(S2)C(=O)NNC(=S)NC3=CC=CC(=C3)C(F)(F)F)Cl

InChI

InChI=1S/C18H13ClF3N3O2S2/c1-27-11-5-6-12-13(8-11)29-15(14(12)19)16(26)24-25-17(28)23-10-4-2-3-9(7-10)18(20,21)22/h2-8H,1H3,(H,24,26)(H2,23,25,28)